2.02012-05-31 14:22:54 -06002015-06-03 17:19:07 -0600ECMDB20014M2MDB000863(R)-3-Hydroxy-3-methyl-2-oxopentanoate(r)-3-hydroxy-3-methyl-2-oxopentanoate belongs to the class of Branched Fatty Acids. These are fatty acids containing a branched chain. (inferred from compound structure)(3R)-3-hydroxy-3-methyl-2-oxopentanoate(3R)-3-hydroxy-3-methyl-2-oxopentanoic acid(R)-3-hydroxy-3-methyl-2-oxopentanoate(R)-3-hydroxy-3-methyl-2-oxopentanoic acid(R)-3-hydroxy-3-methyl-2-oxovalerate(R)-3-hydroxy-3-methyl-2-oxovaleric acidC6H10O4146.1412146.057908808(3R)-3-hydroxy-3-methyl-2-oxopentanoic acid(3R)-3-hydroxy-3-methyl-2-oxopentanoic acidCC[C@@](C)(O)C(=O)C(O)=OInChI=1S/C6H10O4/c1-3-6(2,10)4(7)5(8)9/h10H,3H2,1-2H3,(H,8,9)/t6-/m1/s1YJVOWRAWFXRESP-ZCFIWIBFSA-NOuter membraneInner membranelogp-0.03logs-0.17solubility9.98e+01 g/llogp0.77pka_strongest_acidic3.16pka_strongest_basic-3.7iupac(3R)-3-hydroxy-3-methyl-2-oxopentanoic acidaverage_mass146.1412mono_mass146.057908808smilesCC[C@@](C)(O)C(=O)C(O)=OformulaC6H10O4inchiInChI=1S/C6H10O4/c1-3-6(2,10)4(7)5(8)9/h10H,3H2,1-2H3,(H,8,9)/t6-/m1/s1inchikeyYJVOWRAWFXRESP-ZCFIWIBFSA-Npolar_surface_area74.6refractivity33.42polarizability13.7rotatable_bond_count3acceptor_count4donor_count2physiological_charge-1formal_charge0Valine, leucine and isoleucine biosynthesisec00290Specdb::CMs1088919Specdb::NmrOneD258028Specdb::NmrOneD258029Specdb::NmrOneD258030Specdb::NmrOneD258031Specdb::NmrOneD258032Specdb::NmrOneD258033Specdb::NmrOneD258034Specdb::NmrOneD258035Specdb::NmrOneD258036Specdb::NmrOneD258037Specdb::NmrOneD258038Specdb::NmrOneD258039Specdb::NmrOneD258040Specdb::NmrOneD258041Specdb::NmrOneD258042Specdb::NmrOneD258043Specdb::NmrOneD258044Specdb::NmrOneD258045Specdb::NmrOneD258046Specdb::NmrOneD258047Specdb::MsMs26702Specdb::MsMs26703Specdb::MsMs26704Specdb::MsMs33260Specdb::MsMs33261Specdb::MsMs332621195402610128321C1446349257Kanehisa, M., Goto, S., Sato, Y., Furumichi, M., Tanabe, M. (2012). "KEGG for integration and interpretation of large-scale molecular data sets." Nucleic Acids Res 40:D109-D114.22080510Yurtsever D. (2007). Fatty acid methyl ester profiling of Enterococcus and Esherichia coli for microbial source tracking. M.sc. Thesis. Villanova University: U.S.AKetol-acid reductoisomeraseP05793ILVC_ECOLIilvChttp://ecmdb.ca/proteins/P05793.xml(R) 2,3-Dihydroxy-3-methylvalerate + NADP <> (R)-3-Hydroxy-3-methyl-2-oxopentanoate + NADPH + Hydrogen ionR050682-Aceto-2-hydroxy-butyrate <> (R)-3-Hydroxy-3-methyl-2-oxopentanoateR05069